SYM-[5.5.5]-TRIAZACYCLOPHANE

SpectraBase Compound ID	70OPaLT0nvK
InChI	InChI=1S/C24H33N3/c1-7-25-8-2-22-16-23-5-11-26-9-3-20-13-19(1)14-21(15-20)4-10-27-12-6-24(17-22)18-23/h13-18,25-27H,1-12H2
InChIKey	BSDLUOANDCJQHQ-UHFFFAOYSA-N Google Search
Mol Weight	363.5 g/mol
Molecular Formula	C24H33N3
Exact Mass	363.267448 g/mol

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SpectraBase Spectrum ID	AESorBLkHLG
Name	iso-[5.5.5]triazacyclophane
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C24H33N3
InChI	InChI=1S/C24H33N3/c1-7-25-8-2-22-16-23-5-11-26-9-3-20-13-19(1)14-21(15-20)4-10-27-12-6-24(17-22)18-23/h13-18,25-27H,1-12H2
InChIKey	BSDLUOANDCJQHQ-UHFFFAOYSA-N
Molecular Weight	363.549 g/mol
SMILES	N1CCc2cc3CCNCCc4cc(CC1)cc(CCNCCc(c2)c3)c4
SPLASH	splash10-01p9-0009000000-534dd33d601af3313ac7
Source of Spectrum	KC-0-3374-1
Synonyms	syn-[5.5.5]triazacyclophane 6,16,23-triazatetracyclo[9.9.5.1(3,19).1(9,13)]heptacosa-1,3(26),9(27),10,12,19-hexaene
Wiley ID	826704